V024-8958 Screening compound: [4-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](1-pyrrolidinyl)methanone

V024-8958 Screening compound: [4-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](1-pyrrolidinyl)methanone
V024-8958 Screening compound: [4-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](1-pyrrolidinyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-8958
[4-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](1-pyrrolidinyl)methanone

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V024-8958

Molecular Formula

C21H21ClN4OS (C21 H21 ClN4 OS)

Compound Name

[4-({[4-(3-chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](1-pyrrolidinyl)methanone

IUPAC name

n/a

SMILES

Cc(n1-c2cccc(Cl)c2)nnc1SCc(cc1)ccc1C(N1CCCC1)=O

InChI

InChI=1S/C21H21ClN4OS/c1-15-23-24-21(26(15)19-6-4-5-18(22)13-19)28-14-16-7-9-17(10-8-16)20(27)25-11-2-3-12-25/h4-10,13H,2-3,11-12,14H2,1H3

InChI Key

SWLVDJOOBVAKMM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19784903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.197

Distribution Coefficient, logD

3.197

Water Solubility, LogSw

-3.51

Polar Surface Area

42.775

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V024-8958 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-8958?
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What is the minimum amount of V024-8958 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-8958
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-8958
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V024-8958 available by request